Mol:FL5FECNSS003

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  27  28
M  SBL   1  1  29
M  SMT   1 ^OCH3
M  SBV   1 29   -6.6039    4.5248
S  SKP  8
ID	FL5FECNSS003
KNApSAcK_ID	C00004979
NAME	Patuletin 7-O-sulfate
CAS_RN	33429-81-1
FORMULA	C16H12O11S
EXACTMASS	412.010031916
AVERAGEMASS	412.32588
SMILES	COc(c(O)1)c(cc(O2)c(C(=O)C(O)=C2c(c3)cc(O)c(O)c3)1)OS(O)(=O)=O
M  END

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